methyl 2-cyano-3-(1H-indol-3-yl)prop-2-enoate
Chemical Structure Depiction of
methyl 2-cyano-3-(1H-indol-3-yl)prop-2-enoate
methyl 2-cyano-3-(1H-indol-3-yl)prop-2-enoate
Compound characteristics
| Compound ID: | K781-0936 |
| Compound Name: | methyl 2-cyano-3-(1H-indol-3-yl)prop-2-enoate |
| Molecular Weight: | 226.23 |
| Molecular Formula: | C13 H10 N2 O2 |
| Smiles: | COC(C(=C\c1c[nH]c2ccccc12)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.441 |
| logD: | 2.441 |
| logSw: | -2.7061 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.339 |
| InChI Key: | JRKWEDQGUNBTEE-UHFFFAOYSA-N |